SCHEMBL21872453

SCHEMBL21872453

Cc1cc(N)c(NCC(C)(C)C)c(C(F)F)c1F

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ NUDT1 P36639 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21936235 0.89 IL1B (0.30) —
SCHEMBL21872477 0.83 NUDT1 (0.30) NUDT1
SCHEMBL21872458 0.83 NUDT1 (0.38) NUDT1
SCHEMBL21872960 0.81 NUDT1 (0.41) NUDT1
SCHEMBL25689238 0.79 NUDT1 (0.36) NUDT1
SCHEMBL24900938 0.76 IL1B (0.32) —
SCHEMBL21872967 0.75 NUDT1 (0.33) NUDT1
SCHEMBL21872598 0.75 MEN1 (0.34) —
SCHEMBL21936211 0.73 — —
SCHEMBL24900928 0.72 — —

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3632897-A1 NOVEL BIPHENYL COMPOUND OR SALT THEREOF Taiho Pharmaceutical Co., Ltd. (JP) 2020-04-08 — — EP disclosed
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